SCHEMBL264978

SCHEMBL264978

Cc1c(N)nc(Nc2ccc(CN3CCNCC3)cc2)nc1-c1ccc(Cl)c2[nH]ccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK4 O00444 1/20 0.41
CDK2 P24941 1/20 0.36
FLT3 P36888 1/20 0.36
CCNA1 P78396 1/20 0.36
AXL P30530 6/20 0.36
MERTK Q12866 4/20 0.36
MET P08581 3/20 0.36
CDK1 P06493 3/20 0.35
KDR P35968 3/20 0.35
CCND1 P24385 2/20 0.35
CDK6 Q00534 2/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
FGFR1 P11362 1/20 0.34
MAP3K11 Q16584 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL264977 0.85 CDK1 (0.47) PLK4CDK2FLT3CCNA1AXL
SCHEMBL264391 0.81 TTK (0.50) CDK2CCND1CDK6JAK2CDK4
SCHEMBL264164 0.77 BRD4 (0.45) PLK4AXLMERTKMETUSP2
SCHEMBL265210 0.77 CDK1 (0.47) PLK4CDK1KDRJAK2
SCHEMBL270418 0.74 AXL (0.51) CDK2FLT3CCNA1AXLJAK2
Hydrochloric Acid SCHEMBL264939 0.73 AXL (0.50) CDK2FLT3CCNA1AXLJAK2
SCHEMBL3970782 0.69 PLK4 (0.41) PLK4CDK2FLT3CCNA1AXL
SCHEMBL264622 0.69 ACP1 (0.46) AXLMERTKMETCDK1KDR
SCHEMBL263658 0.67 ACP1 (0.45) AXLMERTKCDK1KDRALDH1A1
SCHEMBL263234 0.67 AXL (0.54) AXLMERTKMET

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8604042-B2 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2013-12-10 US disclosed
US-8138199-B2 Use of bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2012-03-20 US disclosed
US-8133900-B2 Use of bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2012-03-13 US disclosed
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES TARGEGEN, INC. (US) 2011-09-01 US disclosed
US-7825246-B2 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2010-11-02 US disclosed
US-20090286789-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases TARGEGEN, INC. (US) 2009-11-19 US disclosed
US-20090275582-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases IMPACT BIOMEDICINES, INC. 2009-11-05 US disclosed
US-7528143-B2 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2009-05-05 US disclosed
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2007-11-08 US disclosed
US-20070191405-A1 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2007-08-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090286789-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases JAK2, TYK2, LTK PLK4 724/4885CDK2 76/4885FLT3 8/4885
US-20070191405-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 PLK4 440/4885CDK2 14/4885FLT3 7/4885
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 PLK4 440/4885CDK2 14/4885FLT3 7/4885
US-20090275582-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases JAK2, TYK2, JAK3 PLK4 440/4885CDK2 14/4885FLT3 7/4885
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES JAK2, TYK2, JAK3 PLK4 440/4885CDK2 14/4885FLT3 7/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.